Specification of the Molecular Information File (MIF)
Allen, F. H.,
Barnard, J. M.,
Cook, A. P. F. and
Hall, S. R.,
International Tables for Crystallography
(2006).
Vol. G,
ch. 2.4,
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Introduction
Allen, F. H.,
Barnard, J. M.,
Cook, A. P. F. and
Hall, S. R.,
International Tables for Crystallography
(2006).
Vol. G,
Section 2.4.1,
pp. 44-44
[ doi:10.1107/97809553602060000730 ]
Allen, F. H., Barnard, J. M., Cook, A. P. F. &
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Data identification
Allen, F. H.,
Barnard, J. M.,
Cook, A. P. F. and
Hall, S. R.,
International Tables for Crystallography
(2006).
Vol. G,
Section 2.4.4.1,
pp. 45-45
[ doi:10.1107/97809553602060000730 ]
[
more
results from section 2.4.4 in volume G]
Bonding conventions
Allen, F. H.,
Barnard, J. M.,
Cook, A. P. F. and
Hall, S. R.,
International Tables for Crystallography
(2006).
Vol. G,
Section 2.4.6,
pp. 48-48
[ doi:10.1107/97809553602060000730 ]
Stereochemistry and geometry at stereogenic centres
Allen, F. H.,
Barnard, J. M.,
Cook, A. P. F. and
Hall, S. R.,
International Tables for Crystallography
(2006).
Vol. G,
Section 2.4.8,
pp. 48-50
[ doi:10.1107/97809553602060000730 ]
Atoms, bonds and molecular representations
Allen, F. H.,
Barnard, J. M.,
Cook, A. P. F. and
Hall, S. R.,
International Tables for Crystallography
(2006).
Vol. G,
Section 2.4.5,
pp. 47-48
[ doi:10.1107/97809553602060000730 ]
determination of the crystal structure of (+)-3-bromocamphor: the absolute configuration of (+)-camphor. J. Chem. Soc. B, pp. 632–636. Google Scholar
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Structural templates
Allen, F. H.,
Barnard, J. M.,
Cook, A. P. F. and
Hall, S. R.,
International Tables for Crystallography
(2006).
Vol. G,
Section 2.4.7,
pp. 48-48
[ doi:10.1107/97809553602060000730 ]
Historical background
Allen, F. H.,
Barnard, J. M.,
Cook, A. P. F. and
Hall, S. R.,
International Tables for Crystallography
(2006).
Vol. G,
Section 2.4.2,
pp. 44-45
[ doi:10.1107/97809553602060000730 ]
file formats used by computer programs developed at Molecular Design Limited. J. Chem. Inf. Comput. Sci. 32, 244–255. Google Scholar
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Conclusion
Allen, F. H.,
Barnard, J. M.,
Cook, A. P. F. and
Hall, S. R.,
International Tables for Crystallography
(2006).
Vol. G,
Section 2.4.10,
pp. 51-51
[ doi:10.1107/97809553602060000730 ]
MIF query applications
Allen, F. H.,
Barnard, J. M.,
Cook, A. P. F. and
Hall, S. R.,
International Tables for Crystallography
(2006).
Vol. G,
Section 2.4.9,
pp. 50-51
[ doi:10.1107/97809553602060000730 ]
